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CHEBI:218378 - Speciosin T

ChEBI IDCHEBI:218378
ChEBI NameSpeciosin T
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SubmitterMetaboLights
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FormulaC11H16O3
Net Charge0
Average Mass196.246
Monoisotopic Mass196.10994
SMILESCC(C)(O)/C=C/C1=CC(=O)CC[C@@H]1O
InChIInChI=1S/C11H16O3/c1-11(2,14)6-5-8-7-9(12)3-4-10(8)13/h5-7,10,13-14H,3-4H2,1-2H3/b6-5+/t10-/m0/s1
InChIKeyCFHWJKSHYAZNGO-PORFMDCZSA-N
Species of MetaboliteComponentSourceComments
Hexagonia (ncbitaxon:114778) - PubMed (21477823)
ChEBI Ontology
Outgoing Relation(s)
Speciosin T (CHEBI:218378) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(4S)-4-hydroxy-3-[(E)-3-hydroxy-3-methylbut-1-enyl]cyclohex-2-en-1-one
Manual XrefsDatabases
61862557ChemSpider